2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane

C16H32O2Si — CID 174467925

IUPAC2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane
SMILESC=CCC1(CC)CCCC[Si]1(OCCC)OCCC
InChIInChI=1S/C16H32O2Si/c1-5-11-16(8-4)12-9-10-15-19(16,17-13-6-2)18-14-7-3/h5H,1,6-15H2,2-4H3
InChIKeyZTNMOVMDLIMPGF-UHFFFAOYSA-N
MW284.52 g/mol
LogP5.19
Rot. Bonds9

About 2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane

2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane (PubChem CID 174467925) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is 2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane.

Molecular Properties

Compound Name2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane
PubChem CID174467925
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Name2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane
SMILESC=CCC1(CC)CCCC[Si]1(OCCC)OCCC
InChIInChI=1S/C16H32O2Si/c1-5-11-16(8-4)12-9-10-15-19(16,17-13-6-2)18-14-7-3/h5H,1,6-15H2,2-4H3
InChIKeyZTNMOVMDLIMPGF-UHFFFAOYSA-N
XLogP5.19
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.52
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane?
The IUPAC name of 2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane (CID 174467925) is 2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane.
What is the SMILES notation for 2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane?
The canonical SMILES for 2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane is C=CCC1(CC)CCCC[Si]1(OCCC)OCCC.
What is the InChIKey of 2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane?
The InChIKey is ZTNMOVMDLIMPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-5-11-16(8-4)12-9-10-15-19(16,17-13-6-2)18-14-7-3/h5H,1,6-15H2,2-4H3.
What are the key properties of 2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane?
2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane has a molecular weight of 284.52 g/mol, XLogP of 5.19, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-prop-2-enyl-1,1-dipropoxysilinane is sourced from PubChem (CID 174467925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).